3-nitro-4-[[(2-phenylsulfanylphenyl)amino]methyl]benzamide

Systemtic Name: 3-nitro-4-[[(2-phenylsulfanylphenyl)amino]methyl]benzamide Openeye Name: 3-nitro-4-[(2-phenylsulfanylanilino)methyl]benzamide CAS Name: 3-nitro-4-[[2-(phenylthio)anilino]methyl]benzamide IUPAC Name: 3-nitro-4-[(2-phenylsulfanylanilino)methyl]benzamide Traditional Name: 3-nitro-4-[[2-(phenylthio)anilino]methyl]benzamide Formula: C20H17N3O3S MolecularWeight: 379.43228

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)SC2=CC=CC=C2NCC3=C(C=C(C=C3)C(=O)N)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)SC2=CC=CC=C2NCC3=C(C=C(C=C3)C(=O)N)[N+](=O)[O-]

InChI

InChI=1S/C20H17N3O3S/c21-20(24)14-10-11-15(18(12-14)23(25)26)13-22-17-8-4-5-9-19(17)27-16-6-2-1-3-7-16/h1-12,22H,13H2,(H2,21,24)